Please use this identifier to cite or link to this item:
http://hdl.handle.net/10174/24043
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| Title: | Insight into the adsorption of chloramphenicol on a vermiculite surface |
| Authors: | Tri, Nguyen Ngoc
Carvalho, A. J. Palace
Dordio, Ana V.
Nguyen, Minh Tho
Trung, Nguyen Tien |
| Issue Date: | 2018 |
| Citation: | Tri, Nguyen Ngoc; Carvalho, A. J. Palace; Dordio, Ana V.; Nguyen, Minh Tho; Trung, Nguyen Tien. Insight into the adsorption of chloramphenicol on a vermiculite surface, Chemical Physics Letters, 699, 0, 107-114, 2018. |
| Abstract: | Four stable configurations were found upon adsorption of the chloramphenicol on a period slab model of
the vermiculite surface, using the PBE and C09-vdW functionals in a projector-augmented wave (PAW)
method approach. The adsorption is a strong chemisorption process, characterized by an adsorption
energy of 106.5 kcal mol 1 at the most stable configuration. Stability of configurations contributed
mainly by Mg O/Cl attractive electrostatic interactions and C/OAH O hydrogen bonds. It is remarkable
that the vermiculite is found to be a solid material with good potential to be used for adsorption and consequent
removal of this type of antibiotic drugs |
| URI: | 0009-2614
http://hdl.handle.net/10174/24043 |
| Type: | article |
| Appears in Collections: | MARE-UE - Publicações - Artigos em Revistas Internacionais Com Arbitragem Científica
QUI - Publicações - Artigos em Revistas Internacionais Com Arbitragem Científica
CQE - Publicações - Artigos em Revistas Internacionais Com Arbitragem Científica
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CQE - Centro de Química de Évora /
CQE - Publicações - Artigos em Revistas Internacionais Com Arbitragem Científica /
